SCHEMBL3673057

SCHEMBL3673057

O=C(CN1CCCCC1)Nc1n[nH]c2ccc(-c3cn(Cc4ccccc4)nn3)cc12.O=C(O)CN1CCCCC1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 19/20 0.74
HIPK2 Q9H2X6 13/20 0.71
DAPK3 O43293 12/20 0.71
CLK2 P49760 12/20 0.71
CDK5 Q00535 12/20 0.71
DYRK1A Q13627 12/20 0.71
MAP4K5 Q9Y4K4 11/20 0.71
CDK2 P24941 11/20 0.71
PAK4 O96013 11/20 0.71
PRKX P51817 11/20 0.71
CSNK1A1 P48729 10/20 0.71
MELK Q14680 10/20 0.71
CDK7 P50613 10/20 0.71
CDK9 P50750 9/20 0.71
PIM1 P11309 7/20 0.71
PRKACA P17612 7/20 0.71
ROCK2 O75116 7/20 0.71
CLK4 Q9HAZ1 7/20 0.71
MAP4K2 Q12851 7/20 0.71
CDK8 P49336 6/20 0.71

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4284801 0.98 CDC7 (0.77) CDC7HIPK2DAPK3CLK2CDK5
SCHEMBL3671042 0.97 CDC7 (0.78) CDC7HIPK2DAPK3CLK2CDK5
SCHEMBL4298797 0.90 CDC7 (0.76) CDC7HIPK2DAPK3CLK2CDK5
SCHEMBL3668102 0.89 CDC7 (0.75) CDC7HIPK2DAPK3CLK2CDK5
SCHEMBL3668169 0.88 CDC7 (0.70) CDC7HIPK2DAPK3CLK2CDK5
SCHEMBL3668190 0.86 CDC7 (0.72) CDC7HIPK2DAPK3CLK2CDK5
SCHEMBL4291734 0.85 CDC7 (1.00) CDC7HIPK2DAPK3CLK2CDK5
SCHEMBL3673059 0.83 CDC7 (0.63) CDC7HIPK2DAPK3CLK2CDK5
SCHEMBL3666733 0.83 CDC7 (1.00) CDC7HIPK2DAPK3CLK2CDK5
SCHEMBL3672598 0.82 CDC7 (1.00) CDC7HIPK2DAPK3CLK2CDK5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2167491-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS Abbott Laboratories (US) 2010-03-31 EP disclosed
WO-2008154241-A1 5-HETEROARYL SUBSTITUTED INDAZOLES AS KINASE INHIBITORS ABBOTT LABORATORIES (US) 2008-12-18 WO disclosed